[2-[(3S)-3-aminocarbonylpiperidin-1-yl]carbonyl-1,3-dihydroinden-2-yl]-methyl-phenethyl-azanium

Systemtic Name: [2-[(3S)-3-aminocarbonylpiperidin-1-yl]carbonyl-1,3-dihydroinden-2-yl]-methyl-phenethyl-azanium Openeye Name: [2-[(3S)-3-carbamoylpiperidine-1-carbonyl]indan-2-yl]-methyl-phenethyl-ammonium CAS Name: [2-[[(3S)-3-carbamoyl-1-piperidinyl]-oxomethyl]-1,3-dihydroinden-2-yl]-methyl-phenethylammonium IUPAC Name: [2-[(3S)-3-carbamoylpiperidine-1-carbonyl]-1,3-dihydroinden-2-yl]-methyl-phenethylazanium Traditional Name: [2-[(3S)-3-carbamoylpiperidine-1-carbonyl]indan-2-yl]-methyl-phenethyl-ammonium Formula: C25H32N3O2+ MolecularWeight: 406.54048

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCC1=CC=CC=C1)C2(CC3=CC=CC=C3C2)C(=O)N4CCCC(C4)C(=O)N

Isomeric SMILES

C[NH+](CCC1=CC=CC=C1)C2(CC3=CC=CC=C3C2)C(=O)N4CCC[C@@H](C4)C(=O)N

InChI

InChI=1S/C25H31N3O2/c1-27(15-13-19-8-3-2-4-9-19)25(16-20-10-5-6-11-21(20)17-25)24(30)28-14-7-12-22(18-28)23(26)29/h2-6,8-11,22H,7,12-18H2,1H3,(H2,26,29)/p+1/t22-/m0/s1