2-[2-(azocan-1-yl)ethanoylamino]-N-cyclopropyl-benzamide; ethanedioic acid

Systemtic Name: 2-[2-(azocan-1-yl)ethanoylamino]-N-cyclopropyl-benzamide; ethanedioic acid Openeye Name: 2-[[2-(azocan-1-yl)acetyl]amino]-N-cyclopropyl-benzamide; oxalic acid CAS Name: 2-[[2-(1-azocanyl)-1-oxoethyl]amino]-N-cyclopropylbenzamide; oxalic acid IUPAC Name: 2-[[2-(azocan-1-yl)acetyl]amino]-N-cyclopropylbenzamide; oxalic acid Traditional Name: 2-[[2-(azocan-1-yl)acetyl]amino]-N-cyclopropyl-benzamide; oxalic acid Formula: C21H29N3O6 MolecularWeight: 419.47146

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CCC1)CC(=O)NC2=CC=CC=C2C(=O)NC3CC3.C(=O)(C(=O)O)O

Isomeric SMILES

C1CCCN(CCC1)CC(=O)NC2=CC=CC=C2C(=O)NC3CC3.C(=O)(C(=O)O)O

InChI

InChI=1S/C19H27N3O2.C2H2O4/c23-18(14-22-12-6-2-1-3-7-13-22)21-17-9-5-4-8-16(17)19(24)20-15-10-11-15;3-1(4)2(5)6/h4-5,8-9,15H,1-3,6-7,10-14H2,(H,20,24)(H,21,23);(H,3,4)(H,5,6)