2-[4-(4-chlorophenyl)sulfanyl-7-phenylmethoxy-5-propan-2-yl-2,3-dihydro-1H-pyrrolo[1,2-a]indol-3-yl]propanoate

Systemtic Name: 2-[4-(4-chlorophenyl)sulfanyl-7-phenylmethoxy-5-propan-2-yl-2,3-dihydro-1H-pyrrolo[1,2-a]indol-3-yl]propanoate Openeye Name: 2-[7-benzyloxy-4-(4-chlorophenyl)sulfanyl-5-isopropyl-2,3-dihydro-1H-pyrrolo[1,2-a]indol-3-yl]propanoate CAS Name: 2-[4-[(4-chlorophenyl)thio]-7-phenylmethoxy-5-propan-2-yl-2,3-dihydro-1H-pyrrolo[1,2-a]indol-3-yl]propanoate IUPAC Name: 2-[4-(4-chlorophenyl)sulfanyl-7-phenylmethoxy-5-propan-2-yl-2,3-dihydro-1H-pyrrolo[1,2-a]indol-3-yl]propanoate Traditional Name: 2-[7-benzoxy-4-[(4-chlorophenyl)thio]-5-isopropyl-2,3-dihydro-1H-pyrrol[1,2-a]indol-3-yl]propionate Formula: C30H29ClNO3S- MolecularWeight: 519.07416

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=CC2=C1C(=C3N2CCC3C(C)C(=O)[O-])SC4=CC=C(C=C4)Cl)OCC5=CC=CC=C5

Isomeric SMILES

CC(C)C1=CC(=CC2=C1C(=C3N2CCC3C(C)C(=O)[O-])SC4=CC=C(C=C4)Cl)OCC5=CC=CC=C5

InChI

InChI=1S/C30H30ClNO3S/c1-18(2)25-15-22(35-17-20-7-5-4-6-8-20)16-26-27(25)29(36-23-11-9-21(31)10-12-23)28-24(13-14-32(26)28)19(3)30(33)34/h4-12,15-16,18-19,24H,13-14,17H2,1-3H3,(H,33,34)/p-1