2-nitro-3-(phenylmethyl)-4-(pyrrolidin-1-ylmethyl)aniline

Systemtic Name: 2-nitro-3-(phenylmethyl)-4-(pyrrolidin-1-ylmethyl)aniline Openeye Name: 3-benzyl-2-nitro-4-(pyrrolidin-1-ylmethyl)aniline CAS Name: 2-nitro-3-(phenylmethyl)-4-(1-pyrrolidinylmethyl)aniline IUPAC Name: 3-benzyl-2-nitro-4-(pyrrolidin-1-ylmethyl)aniline Traditional Name: [3-benzyl-2-nitro-4-(pyrrolidinomethyl)phenyl]amine Formula: C18H21N3O2 MolecularWeight: 311.37824

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC2=C(C(=C(C=C2)N)[N+](=O)[O-])CC3=CC=CC=C3

Isomeric SMILES

C1CCN(C1)CC2=C(C(=C(C=C2)N)[N+](=O)[O-])CC3=CC=CC=C3

InChI

InChI=1S/C18H21N3O2/c19-17-9-8-15(13-20-10-4-5-11-20)16(18(17)21(22)23)12-14-6-2-1-3-7-14/h1-3,6-9H,4-5,10-13,19H2