2-[4-benzamido-6-methoxycarbonyl-2-(phenylmethyl)-2,3-dihydrochromen-4-yl]ethanoic acid

Systemtic Name: 2-[4-benzamido-6-methoxycarbonyl-2-(phenylmethyl)-2,3-dihydrochromen-4-yl]ethanoic acid Openeye Name: 2-(4-benzamido-2-benzyl-6-methoxycarbonyl-chroman-4-yl)acetic acid CAS Name: 2-[4-benzamido-6-methoxycarbonyl-2-(phenylmethyl)-3,4-dihydro-2H-1-benzopyran-4-yl]acetic acid IUPAC Name: 2-(4-benzamido-2-benzyl-6-methoxycarbonyl-2,3-dihydrochromen-4-yl)acetic acid Traditional Name: 2-(4-benzamido-2-benzyl-6-carbomethoxy-chroman-4-yl)acetic acid Formula: C27H25NO6 MolecularWeight: 459.4905

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)OC(CC2(CC(=O)O)NC(=O)C3=CC=CC=C3)CC4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)OC(CC2(CC(=O)O)NC(=O)C3=CC=CC=C3)CC4=CC=CC=C4

InChI

InChI=1S/C27H25NO6/c1-33-26(32)20-12-13-23-22(15-20)27(17-24(29)30,28-25(31)19-10-6-3-7-11-19)16-21(34-23)14-18-8-4-2-5-9-18/h2-13,15,21H,14,16-17H2,1H3,(H,28,31)(H,29,30)