[1-[2-[(4-azanylbutylamino)methyl]pyrrolidin-1-yl]-1-oxidanylidene-3-phenyl-propan-2-yl]carbamic acid

Systemtic Name: [1-[2-[(4-azanylbutylamino)methyl]pyrrolidin-1-yl]-1-oxidanylidene-3-phenyl-propan-2-yl]carbamic acid Openeye Name: [2-[2-[(4-aminobutylamino)methyl]pyrrolidin-1-yl]-1-benzyl-2-oxo-ethyl]carbamic acid CAS Name: [1-[2-[(4-aminobutylamino)methyl]-1-pyrrolidinyl]-1-oxo-3-phenylpropan-2-yl]carbamic acid IUPAC Name: [1-[2-[(4-aminobutylamino)methyl]pyrrolidin-1-yl]-1-oxo-3-phenylpropan-2-yl]carbamic acid Traditional Name: [2-[2-[(4-aminobutylamino)methyl]pyrrolidino]-1-benzyl-2-keto-ethyl]carbamic acid Formula: C19H30N4O3 MolecularWeight: 362.4665

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H30N4O3/c20-10-4-5-11-21-14-16-9-6-12-23(16)18(24)17(22-19(25)26)13-15-7-2-1-3-8-15/h1-3,7-8,16-17,21-22H,4-6,9-14,20H2,(H,25,26)