[6-chloranyl-4-methyl-2-oxidanylidene-3-(phenylmethyl)chromen-7-yl] 2-(phenylmethoxycarbonylamino)pentanoate

Systemtic Name: [6-chloranyl-4-methyl-2-oxidanylidene-3-(phenylmethyl)chromen-7-yl] 2-(phenylmethoxycarbonylamino)pentanoate Openeye Name: (3-benzyl-6-chloro-4-methyl-2-oxo-chromen-7-yl) 2-(benzyloxycarbonylamino)pentanoate CAS Name: 2-(phenylmethoxycarbonylamino)pentanoic acid [6-chloro-4-methyl-2-oxo-3-(phenylmethyl)-1-benzopyran-7-yl] ester IUPAC Name: (3-benzyl-6-chloro-4-methyl-2-oxochromen-7-yl) 2-(phenylmethoxycarbonylamino)pentanoate Traditional Name: 2-(benzyloxycarbonylamino)valeric acid (3-benzyl-6-chloro-2-keto-4-methyl-chromen-7-yl) ester Formula: C30H28ClNO6 MolecularWeight: 533.99942

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)OC1=C(C=C2C(=C(C(=O)OC2=C1)CC3=CC=CC=C3)C)Cl)NC(=O)OCC4=CC=CC=C4

Isomeric SMILES

CCCC(C(=O)OC1=C(C=C2C(=C(C(=O)OC2=C1)CC3=CC=CC=C3)C)Cl)NC(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C30H28ClNO6/c1-3-10-25(32-30(35)36-18-21-13-8-5-9-14-21)29(34)38-27-17-26-22(16-24(27)31)19(2)23(28(33)37-26)15-20-11-6-4-7-12-20/h4-9,11-14,16-17,25H,3,10,15,18H2,1-2H3,(H,32,35)