methyl 7-(3-acetyloxypropoxy)-5-(methoxycarbonylamino)-4-[(2S)-2-oxidanyl-3-phenylmethoxy-propyl]-1H-indole-2-carboxylate

Systemtic Name: methyl 7-(3-acetyloxypropoxy)-5-(methoxycarbonylamino)-4-[(2S)-2-oxidanyl-3-phenylmethoxy-propyl]-1H-indole-2-carboxylate Openeye Name: methyl 7-(3-acetoxypropoxy)-4-[(2S)-3-benzyloxy-2-hydroxy-propyl]-5-(methoxycarbonylamino)-1H-indole-2-carboxylate CAS Name: 7-(3-acetyloxypropoxy)-4-[(2S)-2-hydroxy-3-phenylmethoxypropyl]-5-(methoxycarbonylamino)-1H-indole-2-carboxylic acid methyl ester IUPAC Name: methyl 7-(3-acetyloxypropoxy)-4-[(2S)-2-hydroxy-3-phenylmethoxypropyl]-5-(methoxycarbonylamino)-1H-indole-2-carboxylate Traditional Name: 7-(3-acetoxypropoxy)-4-[(2S)-3-benzoxy-2-hydroxy-propyl]-5-(carbomethoxyamino)-1H-indole-2-carboxylic acid methyl ester Formula: C27H32N2O9 MolecularWeight: 528.55098

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCCCOC1=C2C(=C(C(=C1)NC(=O)OC)CC(COCC3=CC=CC=C3)O)C=C(N2)C(=O)OC

Isomeric SMILES

CC(=O)OCCCOC1=C2C(=C(C(=C1)NC(=O)OC)C[C@@H](COCC3=CC=CC=C3)O)C=C(N2)C(=O)OC

InChI

InChI=1S/C27H32N2O9/c1-17(30)37-10-7-11-38-24-14-22(29-27(33)35-3)20(21-13-23(26(32)34-2)28-25(21)24)12-19(31)16-36-15-18-8-5-4-6-9-18/h4-6,8-9,13-14,19,28,31H,7,10-12,15-16H2,1-3H3,(H,29,33)/t19-/m0/s1