ethyl 2-[6-[(4-carbamimidoylphenyl)carbonylamino]-4,4-dimethyl-2,3-dihydrochromen-2-yl]ethanoate

Systemtic Name: ethyl 2-[6-[(4-carbamimidoylphenyl)carbonylamino]-4,4-dimethyl-2,3-dihydrochromen-2-yl]ethanoate Openeye Name: ethyl 2-[6-[(4-carbamimidoylbenzoyl)amino]-4,4-dimethyl-chroman-2-yl]acetate CAS Name: 2-[6-[[(4-carbamimidoylphenyl)-oxomethyl]amino]-4,4-dimethyl-3,4-dihydro-2H-1-benzopyran-2-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[6-[(4-carbamimidoylbenzoyl)amino]-4,4-dimethyl-2,3-dihydrochromen-2-yl]acetate Traditional Name: 2-[6-[(4-amidinobenzoyl)amino]-4,4-dimethyl-chroman-2-yl]acetic acid ethyl ester Formula: C23H27N3O4 MolecularWeight: 409.47818

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1CC(C2=C(O1)C=CC(=C2)NC(=O)C3=CC=C(C=C3)C(=N)N)(C)C

Isomeric SMILES

CCOC(=O)CC1CC(C2=C(O1)C=CC(=C2)NC(=O)C3=CC=C(C=C3)C(=N)N)(C)C

InChI

InChI=1S/C23H27N3O4/c1-4-29-20(27)12-17-13-23(2,3)18-11-16(9-10-19(18)30-17)26-22(28)15-7-5-14(6-8-15)21(24)25/h5-11,17H,4,12-13H2,1-3H3,(H3,24,25)(H,26,28)