methyl (2S)-2-[(3aR,6aS)-5-butyl-4-oxidanylidene-1,3,3a,6a-tetrahydrocyclopenta[c]pyrrol-2-yl]-3-(1H-indol-3-yl)propanoate

Systemtic Name: methyl (2S)-2-[(3aR,6aS)-5-butyl-4-oxidanylidene-1,3,3a,6a-tetrahydrocyclopenta[c]pyrrol-2-yl]-3-(1H-indol-3-yl)propanoate Openeye Name: methyl (2S)-2-[(3aR,6aS)-5-butyl-4-oxo-1,3,3a,6a-tetrahydrocyclopenta[c]pyrrol-2-yl]-3-(1H-indol-3-yl)propanoate CAS Name: (2S)-2-[(3aR,6aS)-5-butyl-4-oxo-1,3,3a,6a-tetrahydrocyclopenta[c]pyrrol-2-yl]-3-(1H-indol-3-yl)propanoic acid methyl ester IUPAC Name: methyl (2S)-2-[(3aR,6aS)-5-butyl-4-oxo-1,3,3a,6a-tetrahydrocyclopenta[c]pyrrol-2-yl]-3-(1H-indol-3-yl)propanoate Traditional Name: (2S)-2-[(3aR,6aS)-5-butyl-4-keto-1,3,3a,6a-tetrahydrocyclopenta[c]pyrrol-2-yl]-3-(1H-indol-3-yl)propionic acid methyl ester Formula: C23H28N2O3 MolecularWeight: 380.48002

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC2CN(CC2C1=O)C(CC3=CNC4=CC=CC=C43)C(=O)OC

Isomeric SMILES

CCCCC1=C[C@@H]2CN(C[C@@H]2C1=O)[C@@H](CC3=CNC4=CC=CC=C43)C(=O)OC

InChI

InChI=1S/C23H28N2O3/c1-3-4-7-15-10-17-13-25(14-19(17)22(15)26)21(23(27)28-2)11-16-12-24-20-9-6-5-8-18(16)20/h5-6,8-10,12,17,19,21,24H,3-4,7,11,13-14H2,1-2H3/t17-,19+,21+/m1/s1