N-(2-methoxyphenyl)-4-[2-[(2-methoxyphenyl)carbamoylamino]ethyl]piperazin-4-ium-1-carboxamide

Systemtic Name: N-(2-methoxyphenyl)-4-[2-[(2-methoxyphenyl)carbamoylamino]ethyl]piperazin-4-ium-1-carboxamide Openeye Name: N-(2-methoxyphenyl)-4-[2-[(2-methoxyphenyl)carbamoylamino]ethyl]piperazin-4-ium-1-carboxamide CAS Name: 4-[2-[[(2-methoxyanilino)-oxomethyl]amino]ethyl]-N-(2-methoxyphenyl)-1-piperazin-4-iumcarboxamide IUPAC Name: N-(2-methoxyphenyl)-4-[2-[(2-methoxyphenyl)carbamoylamino]ethyl]piperazin-4-ium-1-carboxamide Traditional Name: N-(2-methoxyphenyl)-4-[2-[(2-methoxyphenyl)carbamoylamino]ethyl]piperazin-4-ium-1-carboxamide Formula: C22H30N5O4+ MolecularWeight: 428.5047

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NC(=O)NCC[NH+]2CCN(CC2)C(=O)NC3=CC=CC=C3OC

Isomeric SMILES

COC1=CC=CC=C1NC(=O)NCC[NH+]2CCN(CC2)C(=O)NC3=CC=CC=C3OC

InChI

InChI=1S/C22H29N5O4/c1-30-19-9-5-3-7-17(19)24-21(28)23-11-12-26-13-15-27(16-14-26)22(29)25-18-8-4-6-10-20(18)31-2/h3-10H,11-16H2,1-2H3,(H,25,29)(H2,23,24,28)/p+1