[2-[2-[4-benzamidobutyl-(phenylmethyl)amino]ethoxy]phenyl] nitrate

Systemtic Name: [2-[2-[4-benzamidobutyl-(phenylmethyl)amino]ethoxy]phenyl] nitrate Openeye Name: [2-[2-[4-benzamidobutyl(benzyl)amino]ethoxy]phenyl] nitrate CAS Name: nitric acid [2-[2-[4-benzamidobutyl-(phenylmethyl)amino]ethoxy]phenyl] ester IUPAC Name: [2-[2-[4-benzamidobutyl(benzyl)amino]ethoxy]phenyl] nitrate Traditional Name: nitric acid [2-[2-[4-benzamidobutyl(benzyl)amino]ethoxy]phenyl] ester Formula: C26H29N3O5 MolecularWeight: 463.52556

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN(CCCCNC(=O)C2=CC=CC=C2)CCOC3=CC=CC=C3O[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CN(CCCCNC(=O)C2=CC=CC=C2)CCOC3=CC=CC=C3O[N+](=O)[O-]

InChI

InChI=1S/C26H29N3O5/c30-26(23-13-5-2-6-14-23)27-17-9-10-18-28(21-22-11-3-1-4-12-22)19-20-33-24-15-7-8-16-25(24)34-29(31)32/h1-8,11-16H,9-10,17-21H2,(H,27,30)