(3S)-3-(1H-indol-3-yl)-3-(4-methoxyphenyl)-N-(2-morpholin-4-ium-4-ylethyl)propanamide

Systemtic Name: (3S)-3-(1H-indol-3-yl)-3-(4-methoxyphenyl)-N-(2-morpholin-4-ium-4-ylethyl)propanamide Openeye Name: (3S)-3-(1H-indol-3-yl)-3-(4-methoxyphenyl)-N-(2-morpholin-4-ium-4-ylethyl)propanamide CAS Name: (3S)-3-(1H-indol-3-yl)-3-(4-methoxyphenyl)-N-[2-(4-morpholin-4-iumyl)ethyl]propanamide IUPAC Name: (3S)-3-(1H-indol-3-yl)-3-(4-methoxyphenyl)-N-(2-morpholin-4-ium-4-ylethyl)propanamide Traditional Name: (3S)-3-(1H-indol-3-yl)-3-(4-methoxyphenyl)-N-(2-morpholin-4-ium-4-ylethyl)propionamide Formula: C24H30N3O3+ MolecularWeight: 408.5133

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(CC(=O)NCC[NH+]2CCOCC2)C3=CNC4=CC=CC=C43

Isomeric SMILES

COC1=CC=C(C=C1)[C@H](CC(=O)NCC[NH+]2CCOCC2)C3=CNC4=CC=CC=C43

InChI

InChI=1S/C24H29N3O3/c1-29-19-8-6-18(7-9-19)21(22-17-26-23-5-3-2-4-20(22)23)16-24(28)25-10-11-27-12-14-30-15-13-27/h2-9,17,21,26H,10-16H2,1H3,(H,25,28)/p+1/t21-/m0/s1