[1-[2-[(3-azanylpropylamino)methyl]pyrrolidin-1-yl]-1-oxidanylidene-3-phenyl-propan-2-yl]carbamic acid

Systemtic Name: [1-[2-[(3-azanylpropylamino)methyl]pyrrolidin-1-yl]-1-oxidanylidene-3-phenyl-propan-2-yl]carbamic acid Openeye Name: [2-[2-[(3-aminopropylamino)methyl]pyrrolidin-1-yl]-1-benzyl-2-oxo-ethyl]carbamic acid CAS Name: [1-[2-[(3-aminopropylamino)methyl]-1-pyrrolidinyl]-1-oxo-3-phenylpropan-2-yl]carbamic acid IUPAC Name: [1-[2-[(3-aminopropylamino)methyl]pyrrolidin-1-yl]-1-oxo-3-phenylpropan-2-yl]carbamic acid Traditional Name: [2-[2-[(3-aminopropylamino)methyl]pyrrolidino]-1-benzyl-2-keto-ethyl]carbamic acid Formula: C18H28N4O3 MolecularWeight: 348.43992

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C(CC2=CC=CC=C2)NC(=O)O)CNCCCN

Isomeric SMILES

C1CC(N(C1)C(=O)C(CC2=CC=CC=C2)NC(=O)O)CNCCCN

InChI

InChI=1S/C18H28N4O3/c19-9-5-10-20-13-15-8-4-11-22(15)17(23)16(21-18(24)25)12-14-6-2-1-3-7-14/h1-3,6-7,15-16,20-21H,4-5,8-13,19H2,(H,24,25)