1-[(6-methoxynaphthalen-2-yl)methyl]-3-[(2S)-4-methyl-2-morpholin-4-ium-4-yl-pentyl]urea

Systemtic Name: 1-[(6-methoxynaphthalen-2-yl)methyl]-3-[(2S)-4-methyl-2-morpholin-4-ium-4-yl-pentyl]urea Openeye Name: 1-[(6-methoxy-2-naphthyl)methyl]-3-[(2S)-4-methyl-2-morpholin-4-ium-4-yl-pentyl]urea CAS Name: 1-[(6-methoxy-2-naphthalenyl)methyl]-3-[(2S)-4-methyl-2-(4-morpholin-4-iumyl)pentyl]urea IUPAC Name: 1-[(6-methoxynaphthalen-2-yl)methyl]-3-[(2S)-4-methyl-2-morpholin-4-ium-4-ylpentyl]urea Traditional Name: 1-[(6-methoxy-2-naphthyl)methyl]-3-[(2S)-4-methyl-2-morpholin-4-ium-4-yl-pentyl]urea Formula: C23H34N3O3+ MolecularWeight: 400.53436

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(CNC(=O)NCC1=CC2=C(C=C1)C=C(C=C2)OC)[NH+]3CCOCC3

Isomeric SMILES

CC(C)C[C@@H](CNC(=O)NCC1=CC2=C(C=C1)C=C(C=C2)OC)[NH+]3CCOCC3

InChI

InChI=1S/C23H33N3O3/c1-17(2)12-21(26-8-10-29-11-9-26)16-25-23(27)24-15-18-4-5-20-14-22(28-3)7-6-19(20)13-18/h4-7,13-14,17,21H,8-12,15-16H2,1-3H3,(H2,24,25,27)/p+1/t21-/m0/s1