propan-2-yl 3-azanyl-4-oxidanylidene-5-[4-(4-phenylbutoxy)phenyl]carbonyl-chromene-2-carboxylate

Systemtic Name: propan-2-yl 3-azanyl-4-oxidanylidene-5-[4-(4-phenylbutoxy)phenyl]carbonyl-chromene-2-carboxylate Openeye Name: isopropyl 3-amino-4-oxo-5-[4-(4-phenylbutoxy)benzoyl]chromene-2-carboxylate CAS Name: 3-amino-4-oxo-5-[oxo-[4-(4-phenylbutoxy)phenyl]methyl]-1-benzopyran-2-carboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 3-amino-4-oxo-5-[4-(4-phenylbutoxy)benzoyl]chromene-2-carboxylate Traditional Name: 3-amino-4-keto-5-[4-(4-phenylbutoxy)benzoyl]chromene-2-carboxylic acid isopropyl ester Formula: C30H29NO6 MolecularWeight: 499.55436

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1=C(C(=O)C2=C(C=CC=C2O1)C(=O)C3=CC=C(C=C3)OCCCCC4=CC=CC=C4)N

Isomeric SMILES

CC(C)OC(=O)C1=C(C(=O)C2=C(C=CC=C2O1)C(=O)C3=CC=C(C=C3)OCCCCC4=CC=CC=C4)N

InChI

InChI=1S/C30H29NO6/c1-19(2)36-30(34)29-26(31)28(33)25-23(12-8-13-24(25)37-29)27(32)21-14-16-22(17-15-21)35-18-7-6-11-20-9-4-3-5-10-20/h3-5,8-10,12-17,19H,6-7,11,18,31H2,1-2H3