(3-methyl-6-oxidanylidene-7,8,9,10-tetrahydrobenzo[c]chromen-1-yl) 3-(phenylmethoxycarbonylamino)propanoate

Systemtic Name: (3-methyl-6-oxidanylidene-7,8,9,10-tetrahydrobenzo[c]chromen-1-yl) 3-(phenylmethoxycarbonylamino)propanoate Openeye Name: (3-methyl-6-oxo-7,8,9,10-tetrahydrobenzo[c]chromen-1-yl) 3-(benzyloxycarbonylamino)propanoate CAS Name: 3-(phenylmethoxycarbonylamino)propanoic acid (3-methyl-6-oxo-7,8,9,10-tetrahydrobenzo[c][1]benzopyran-1-yl) ester IUPAC Name: (3-methyl-6-oxo-7,8,9,10-tetrahydrobenzo[c]chromen-1-yl) 3-(phenylmethoxycarbonylamino)propanoate Traditional Name: 3-(benzyloxycarbonylamino)propionic acid (6-keto-3-methyl-7,8,9,10-tetrahydrobenzo[c]chromen-1-yl) ester Formula: C25H25NO6 MolecularWeight: 435.4691

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C3=C(CCCC3)C(=O)O2)C(=C1)OC(=O)CCNC(=O)OCC4=CC=CC=C4

Isomeric SMILES

CC1=CC2=C(C3=C(CCCC3)C(=O)O2)C(=C1)OC(=O)CCNC(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C25H25NO6/c1-16-13-20(23-18-9-5-6-10-19(18)24(28)32-21(23)14-16)31-22(27)11-12-26-25(29)30-15-17-7-3-2-4-8-17/h2-4,7-8,13-14H,5-6,9-12,15H2,1H3,(H,26,29)