sulfamoyl 2-[(7-carbamimidoylnaphthalen-2-yl)methyl-ethoxycarbonyl-amino]-2-[2-(1-ethanimidoylpiperidin-4-yl)oxyphenyl]ethanoate

Systemtic Name: sulfamoyl 2-[(7-carbamimidoylnaphthalen-2-yl)methyl-ethoxycarbonyl-amino]-2-[2-(1-ethanimidoylpiperidin-4-yl)oxyphenyl]ethanoate Openeye Name: sulfamoyl 2-[(7-carbamimidoyl-2-naphthyl)methyl-ethoxycarbonyl-amino]-2-[2-[(1-ethanimidoyl-4-piperidyl)oxy]phenyl]acetate CAS Name: 2-[(7-carbamimidoyl-2-naphthalenyl)methyl-ethoxycarbonylamino]-2-[2-[[1-(1-iminoethyl)-4-piperidinyl]oxy]phenyl]acetic acid sulfamoyl ester IUPAC Name: sulfamoyl 2-[(7-carbamimidoylnaphthalen-2-yl)methyl-ethoxycarbonylamino]-2-[2-(1-ethanimidoylpiperidin-4-yl)oxyphenyl]acetate Traditional Name: 2-[2-[(1-acetimidoyl-4-piperidyl)oxy]phenyl]-2-[(7-amidino-2-naphthyl)methyl-carbethoxy-amino]acetic acid sulfamoyl ester Formula: C30H36N6O7S MolecularWeight: 624.70784

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N(CC1=CC2=C(C=C1)C=CC(=C2)C(=N)N)C(C3=CC=CC=C3OC4CCN(CC4)C(=N)C)C(=O)OS(=O)(=O)N

Isomeric SMILES

CCOC(=O)N(CC1=CC2=C(C=C1)C=CC(=C2)C(=N)N)C(C3=CC=CC=C3OC4CCN(CC4)C(=N)C)C(=O)OS(=O)(=O)N

InChI

InChI=1S/C30H36N6O7S/c1-3-41-30(38)36(18-20-8-9-21-10-11-22(28(32)33)17-23(21)16-20)27(29(37)43-44(34,39)40)25-6-4-5-7-26(25)42-24-12-14-35(15-13-24)19(2)31/h4-11,16-17,24,27,31H,3,12-15,18H2,1-2H3,(H3,32,33)(H2,34,39,40)