(2-chloranyl-6-oxidanylidene-7,8,9,10-tetrahydrobenzo[c]chromen-3-yl) 3-(phenylmethoxycarbonylamino)propanoate

Systemtic Name: (2-chloranyl-6-oxidanylidene-7,8,9,10-tetrahydrobenzo[c]chromen-3-yl) 3-(phenylmethoxycarbonylamino)propanoate Openeye Name: (2-chloro-6-oxo-7,8,9,10-tetrahydrobenzo[c]chromen-3-yl) 3-(benzyloxycarbonylamino)propanoate CAS Name: 3-(phenylmethoxycarbonylamino)propanoic acid (2-chloro-6-oxo-7,8,9,10-tetrahydrobenzo[c][1]benzopyran-3-yl) ester IUPAC Name: (2-chloro-6-oxo-7,8,9,10-tetrahydrobenzo[c]chromen-3-yl) 3-(phenylmethoxycarbonylamino)propanoate Traditional Name: 3-(benzyloxycarbonylamino)propionic acid (2-chloro-6-keto-7,8,9,10-tetrahydrobenzo[c]chromen-3-yl) ester Formula: C24H22ClNO6 MolecularWeight: 455.88758

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C3=CC(=C(C=C3OC2=O)OC(=O)CCNC(=O)OCC4=CC=CC=C4)Cl

Isomeric SMILES

C1CCC2=C(C1)C3=CC(=C(C=C3OC2=O)OC(=O)CCNC(=O)OCC4=CC=CC=C4)Cl

InChI

InChI=1S/C24H22ClNO6/c25-19-12-18-16-8-4-5-9-17(16)23(28)32-20(18)13-21(19)31-22(27)10-11-26-24(29)30-14-15-6-2-1-3-7-15/h1-3,6-7,12-13H,4-5,8-11,14H2,(H,26,29)