2-[[6-chloranyl-2-(3-methoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)-7-methyl-chromen-4-yl]amino]-3-(1H-imidazol-5-yl)propanoate

Systemtic Name: 2-[[6-chloranyl-2-(3-methoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)-7-methyl-chromen-4-yl]amino]-3-(1H-imidazol-5-yl)propanoate Openeye Name: 2-[[6-chloro-2-(3-methoxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)-7-methyl-chromen-4-yl]amino]-3-(1H-imidazol-5-yl)propanoate CAS Name: 2-[[6-chloro-2-(3-methoxy-4-oxo-1-cyclohexa-2,5-dienylidene)-7-methyl-1-benzopyran-4-yl]amino]-3-(1H-imidazol-5-yl)propanoate IUPAC Name: 2-[[6-chloro-2-(3-methoxy-4-oxocyclohexa-2,5-dien-1-ylidene)-7-methylchromen-4-yl]amino]-3-(1H-imidazol-5-yl)propanoate Traditional Name: 2-[[6-chloro-2-(4-keto-3-methoxy-cyclohexa-2,5-dien-1-ylidene)-7-methyl-chromen-4-yl]amino]-3-(1H-imidazol-5-yl)propionate Formula: C23H19ClN3O5- MolecularWeight: 452.86706

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=C3C=CC(=O)C(=C3)OC)OC2=C1)NC(CC4=CN=CN4)C(=O)[O-])Cl

Isomeric SMILES

CC1=C(C=C2C(=CC(=C3C=CC(=O)C(=C3)OC)OC2=C1)NC(CC4=CN=CN4)C(=O)[O-])Cl

InChI

InChI=1S/C23H20ClN3O5/c1-12-5-21-15(8-16(12)24)17(27-18(23(29)30)7-14-10-25-11-26-14)9-20(32-21)13-3-4-19(28)22(6-13)31-2/h3-6,8-11,18,27H,7H2,1-2H3,(H,25,26)(H,29,30)/p-1