cyclopentyl-[(2S)-3-(5,7-dimethyl-2,3-diphenyl-indol-1-yl)-2-oxidanyl-propyl]azanium

Systemtic Name: cyclopentyl-[(2S)-3-(5,7-dimethyl-2,3-diphenyl-indol-1-yl)-2-oxidanyl-propyl]azanium Openeye Name: cyclopentyl-[(2S)-3-(5,7-dimethyl-2,3-diphenyl-indol-1-yl)-2-hydroxy-propyl]ammonium CAS Name: cyclopentyl-[(2S)-3-(5,7-dimethyl-2,3-diphenyl-1-indolyl)-2-hydroxypropyl]ammonium IUPAC Name: cyclopentyl-[(2S)-3-(5,7-dimethyl-2,3-diphenylindol-1-yl)-2-hydroxypropyl]azanium Traditional Name: cyclopentyl-[(2S)-3-(5,7-dimethyl-2,3-diphenyl-indol-1-yl)-2-hydroxy-propyl]ammonium Formula: C30H35N2O+ MolecularWeight: 439.6117

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C(=C(N2CC(C[NH2+]C3CCCC3)O)C4=CC=CC=C4)C5=CC=CC=C5)C

Isomeric SMILES

CC1=CC(=C2C(=C1)C(=C(N2C[C@H](C[NH2+]C3CCCC3)O)C4=CC=CC=C4)C5=CC=CC=C5)C

InChI

InChI=1S/C30H34N2O/c1-21-17-22(2)29-27(18-21)28(23-11-5-3-6-12-23)30(24-13-7-4-8-14-24)32(29)20-26(33)19-31-25-15-9-10-16-25/h3-8,11-14,17-18,25-26,31,33H,9-10,15-16,19-20H2,1-2H3/p+1/t26-/m0/s1