1-[(3S)-1-cycloheptylpiperidin-1-ium-3-yl]-3-(1H-indol-3-yl)urea

Systemtic Name: 1-[(3S)-1-cycloheptylpiperidin-1-ium-3-yl]-3-(1H-indol-3-yl)urea Openeye Name: 1-[(3S)-1-cycloheptylpiperidin-1-ium-3-yl]-3-(1H-indol-3-yl)urea CAS Name: 1-[(3S)-1-cycloheptyl-3-piperidin-1-iumyl]-3-(1H-indol-3-yl)urea IUPAC Name: 1-[(3S)-1-cycloheptylpiperidin-1-ium-3-yl]-3-(1H-indol-3-yl)urea Traditional Name: 1-[(3S)-1-cycloheptylpiperidin-1-ium-3-yl]-3-(1H-indol-3-yl)urea Formula: C21H31N4O+ MolecularWeight: 355.49704

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)[NH+]2CCCC(C2)NC(=O)NC3=CNC4=CC=CC=C43

Isomeric SMILES

C1CCCC(CC1)[NH+]2CCC[C@@H](C2)NC(=O)NC3=CNC4=CC=CC=C43

InChI

InChI=1S/C21H30N4O/c26-21(24-20-14-22-19-12-6-5-11-18(19)20)23-16-8-7-13-25(15-16)17-9-3-1-2-4-10-17/h5-6,11-12,14,16-17,22H,1-4,7-10,13,15H2,(H2,23,24,26)/p+1/t16-/m0/s1