ethyl 2-[[3-[3-(4-carbamimidoylphenyl)propanoyl]-1-methyl-indol-5-yl]carbonyl-ethyl-amino]ethanoate

Systemtic Name: ethyl 2-[[3-[3-(4-carbamimidoylphenyl)propanoyl]-1-methyl-indol-5-yl]carbonyl-ethyl-amino]ethanoate Openeye Name: ethyl 2-[[3-[3-(4-carbamimidoylphenyl)propanoyl]-1-methyl-indole-5-carbonyl]-ethyl-amino]acetate CAS Name: 2-[[[3-[3-(4-carbamimidoylphenyl)-1-oxopropyl]-1-methyl-5-indolyl]-oxomethyl]-ethylamino]acetic acid ethyl ester IUPAC Name: ethyl 2-[[3-[3-(4-carbamimidoylphenyl)propanoyl]-1-methylindole-5-carbonyl]-ethylamino]acetate Traditional Name: 2-[[3-[3-(4-amidinophenyl)propanoyl]-1-methyl-indole-5-carbonyl]-ethyl-amino]acetic acid ethyl ester Formula: C26H30N4O4 MolecularWeight: 462.5408

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC(=O)OCC)C(=O)C1=CC2=C(C=C1)N(C=C2C(=O)CCC3=CC=C(C=C3)C(=N)N)C

Isomeric SMILES

CCN(CC(=O)OCC)C(=O)C1=CC2=C(C=C1)N(C=C2C(=O)CCC3=CC=C(C=C3)C(=N)N)C

InChI

InChI=1S/C26H30N4O4/c1-4-30(16-24(32)34-5-2)26(33)19-11-12-22-20(14-19)21(15-29(22)3)23(31)13-8-17-6-9-18(10-7-17)25(27)28/h6-7,9-12,14-15H,4-5,8,13,16H2,1-3H3,(H3,27,28)